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CHEBI:160663 - Met-Gln-Ile

Default Structure
ChEBI IDCHEBI:160663
ChEBI NameMet-Gln-Ile
Stars
Last Modified20 March 2025
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H30N4O5S
Net Charge0
Average Mass390.506
Monoisotopic Mass390.19369
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCSC)C(=O)O
InChIInChI=1S/C16H30N4O5S/c1-4-9(2)13(16(24)25)20-15(23)11(5-6-12(18)21)19-14(22)10(17)7-8-26-3/h9-11,13H,4-8,17H2,1-3H3,(H2,18,21)(H,19,22)(H,20,23)(H,24,25)/t9-,10-,11-,13-/m0/s1
InChIKeyAWOMRHGUWFBDNU-ZPFDUUQYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Met-Gln-Ile (CHEBI:160663) is a tripeptide (CHEBI:47923)
IUPAC Name 
(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoic acid